Vitas-M small molecule compound

2-[1-(2,6-dioxocyclohexyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-oxoethyl morpholine-4-carbodithioate

Catalog ID
STL326465
SMILES COc1cc2c(cc1OC)CCN(C2C1C(=O)CCCC1=O)C(=O)CSC(=S)N1CCOCC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H30N2O6S2 MW 506.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2O6S2/c1-30-19-12-15-6-7-26(21(29)14-34-24(33)25-8-10-32-11-9-25)23(16(15)13-20(19)31-2)22-17(27)4-3-5-18(22)28/h12-13,22-23H,3-11,14H2,1-2H3
InChIKey
SUHPZNLKRBTZET-UHFFFAOYSA-N
Synonyms
372154-63-7
(2(1(26DIOXOCYCLOHEXYL)67DIMETHOXY34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)MORPHOLINE4CARBODITHIOATE
2(1(26dioxocyclohexyl)67dimethoxy34dihydroisoquinolin2(1H)yl)2oxoethylmorpholine4carbodithioate
372154637
COC1=C(C=C2C(N(CCC2=C1)C(=O)CSC(=S)N3CCOCC3)C4C(=O)CCCC4=O)OC
InChI=1SC24H30N2O6S2c1301912156726(21(29)143424(33)258103211925)23(16(15)1320(19)312)2217(27)43518(22)28h12132223H31114H212H3
MFCD01217796
ZINC000100708279
ZINC000100708281

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Available files

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